2'-Deoxy-5'-O-[({[(1R)-1-Fluoro-1-Phosphonoethyl](Hydroxy)Phosphoryl}Oxy)(Hydroxy)Phosphoryl]Guanosine

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Properties Simple | Detailed

Formula C12H20FN5O12P3
IUPAC Name [(1r)-1-[[[(2r,3s,5r)-5-(2-amino-6-oxo-3h-purine-1,7-diium-4-id-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]-1-fluoro-ethyl]phosphonic acid
Molecular Mass 538.233 g·mol−1
Heat of Formation -2991.1 ± 16.7 kJ·mol−1
Dipole Moment 12.54 ± 1.08 D
Volume 513.75 Å 3
Surface Area 376.73 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy -1.71 ± eV
Point Group Symmetry C1
InChIKey MKPYQNARCBWQRN-WGVJZOHMSA-N
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